| Code |
Monomeric form |
Dimer |
SMILES |
Monomeric form bond atoms |
Monomeric form displaced atoms |
Left bond atoms |
Left displaced atoms |
Right bond atoms |
Right displaced atoms |
| A |
|
|
C[C@H]([NH3+])C=O |
C8 |
H8 |
C8 |
|
N4 |
H4, H4 |
| R |
|
|
O=C[C@H](CCCNC(=[NH2+])N)[NH3+] |
C2 |
H2 |
C2 |
|
N14 |
H14, H14 |
| N |
|
|
NC(=O)C[C@H]([NH3+])C=O |
C11 |
H11 |
C11 |
|
N7 |
H7, H7 |
| D |
|
|
O=C[C@H](CC(=O)[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N9 |
H9, H9 |
| C |
|
|
SC[C@H]([NH3+])C=O |
C9 |
H9 |
C9 |
|
N5 |
H5, H5 |
| Q |
|
|
O=C[C@H](CCC(=O)N)[NH3+] |
C2 |
H2 |
C2 |
|
N10 |
H10, H10 |
| E |
|
|
O=C[C@H](CCC(=O)[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N10 |
H10, H10 |
| G |
|
|
C([NH3+])C=O |
C6 |
H6 |
C6 |
|
N2 |
H2, H2 |
| H |
|
|
C(c1c[nH]cn1)[C@H]([NH3+])C=O |
C14 |
H14 |
C14 |
|
N10 |
H10, H10 |
| I |
|
|
CC[C@@H]([C@@H](C=O)[NH3+])C |
C7 |
H7 |
C7 |
|
N9 |
H9, H9 |
| L |
|
|
O=C[C@H](CC(C)C)[NH3+] |
C2 |
H2 |
C2 |
|
N9 |
H9, H9 |
| K |
|
|
O=C[C@H](CCCC[NH3+])[NH3+] |
C2 |
H2 |
C2 |
|
N13 |
H13, H13 |
| M |
|
|
CSCC[C@H]([NH3+])C=O |
C11 |
H11 |
C11 |
|
N7 |
H7, H7 |
| F |
|
|
O=C[C@H](Cc1ccccc1)[NH3+] |
C2 |
H2 |
C2 |
|
N12 |
H12, H12 |
| P |
|
|
O=C[C@@H]1CCC[NH2+]1 |
C2 |
H2 |
C2 |
|
N8 |
H8, H8 |
| S |
|
|
OC[C@H]([NH3+])C=O |
C9 |
H9 |
C9 |
|
N5 |
H5, H5 |
| T |
|
|
C[C@H]([C@H]([NH3+])C=O)O |
C10 |
H10 |
C10 |
|
N6 |
H6, H6 |
| W |
|
|
O=C[C@H](Cc1c[nH]c2c1cccc2)[NH3+] |
C2 |
H2 |
C2 |
|
N16 |
H16, H16 |
| Y |
|
|
O=C[C@H](Cc1ccc(cc1)O)[NH3+] |
C2 |
H2 |
C2 |
|
N13 |
H13, H13 |
| V |
|
|
CC(C)C([NH3+])C=O |
C9 |
H9 |
C9 |
|
N5 |
H5, H5 |
| AA0567 |
|
|
C/C=C/C(=O)NCCCC[C@@H](C=O)[NH3+] |
C13 |
H13 |
C13 |
|
N15 |
H15, H15 |
| AA0037 |
|
|
O=C[C@H](COP(=O)([O-])[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N11 |
H11, H11 |
| C, S |
|
|
O=C[C@H](CS[C@@](C=O)(CO)N)[NH3+] |
C2 |
H2 |
C2 |
|
N13 |
H13, H13 |
| AA0560 |
|
|
O=C[C@H](CS[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1NC(=O)C)O)O)[NH3+] |
C2 |
H2 |
C2 |
|
N26 |
H26, H26 |
| AA0172 |
|
|
O=C[C@H](Cc1ccc(cc1)OS(=O)(=O)[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N17 |
H17, H17 |
| AA0150 |
|
|
SCCNC(=O)CCNC(=O)[C@H](C(COP(=O)(OC[C@@H](C=O)[NH3+])[O-])(C)C)O |
C23 |
H23 |
C23 |
|
N25 |
H25, H25 |
| AA0177 |
|
|
O=C[C@H](Cc1cc(I)c(c(c1)I)Oc1ccc(c(c1)I)O)[NH3+] |
C2 |
H2 |
C2 |
|
N23 |
H23, H23 |
| AA0530 |
|
|
O=C[C@H](CCCCNC(=O)[C@H](CCCC[NH3+])[NH3+])[NH3+] |
C2 |
H2 |
C2 |
|
N26 |
H26, H26 |
| AA0577 |
|
|
O=C[C@H](Cc1ccc(cc1)O[C@H]1O[C@@H](CO)[C@@H]([C@@H]([C@@H]1NC(=O)C)O)O)[NH3+] |
C2 |
H2 |
C2 |
|
N32 |
H32, H32 |
| AA0133 |
|
|
O=C[C@H](CS[C@@H]([C@H]1C(=C[C@H]2[NH2+]C(=Cc3[nH]c(c(c3CCC(=O)[O-])C)C=C3NC(=O)C(=C3C)C=C)C(=C2C)CCC(=O)[O-])NC(=O)[C@H]1C)C)[NH3+] |
C2 |
H2 |
C2 |
|
N57 |
H57, H57 |
| AA0290 |
|
|
CCCCCCCC(=O)OC[C@@H](C=O)[NH3+] |
C14 |
H14 |
C14 |
|
N16 |
H16, H16 |
| AA0526 |
|
|
O=C[C@H](CS[C@@H](c1nc2n(c1=O)cc([nH]c2Cc1ccccc1)c1ccc(cc1)O)c1ccc(cc1)O)[NH3+] |
C2 |
H2 |
C2 |
|
N41 |
H41, H41 |
| AA0119 |
|
|
O=C[C@H](CCCC[NH2+]Cc1c(cnc(c1O)C)COP(=O)([O-])[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N27 |
H27, H27 |
| AA0067 |
|
|
CNC(NCCC[C@@H](C=O)[NH3+])NC |
C10 |
H10 |
C10 |
|
N12 |
H12, H12 |
| AA0120 |
|
|
O=C[C@H](CCCC[NH2+]C=C[C@H](C=CC=C(C=CC1=C(C)CCCC1(C)C)C)C)[NH3+] |
C2 |
H2 |
C2 |
|
N33 |
H33, H33 |
| AA0274 |
|
|
SC[C@H]([NH2+][C@H](C(=O)[O-])C)C=O |
C14 |
H14 |
C14 |
|
N5 |
H5, H5 |
| AA0075 |
|
|
O=C[C@H](CCCC[NH+](C)C)[NH3+] |
C2 |
H2 |
C2 |
|
N13 |
H13, H13 |
| AA0190 |
|
|
O=C[C@@H](CC(=O)[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N9 |
H9, H9 |
| AA0193 |
|
|
CSCC[C@@H]([NH3+])C=O |
C11 |
H11 |
C11 |
|
N7 |
H7, H7 |
| G, T |
|
|
C[C@H]([C@H]([NH3+])C=O)OC(=O)CN |
C10 |
H10 |
C10 |
|
N6 |
H6, H6 |
| AA0388 |
|
|
OC[C@H]([C@H](C=O)[NH3+])C |
C7 |
H7 |
C7 |
|
N9 |
H9, H9 |
| F, S |
|
|
O=C[C@H](COC(=O)[C@H](Cc1ccccc1)N)[NH3+] |
C2 |
H2 |
C2 |
|
N19 |
H19, H19 |
| AA0278 |
|
|
O=C[C@H](CCCC[NH2+]CCCNCCC[NH+](CCCN(CCC[NH+](CCCN(CCC[NH+](C)C)C)C)C)C)[NH3+] |
C2 |
H2 |
C2 |
|
N45 |
H45, H45 |
| C, Y |
|
|
O=C[C@](Cc1ccc(cc1)O)(SC[C@@H](C=O)[NH3+])N |
C16 |
H16 |
C16 |
|
N18 |
H18, H18 |
| AA0117 |
|
|
O=C[C@H](CCCCNC(=O)CCCC[C@@H]1SC[C@H]2[C@@H]1NC(=O)N2)[NH3+] |
C2 |
H2 |
C2 |
|
N28 |
H28, H28 |
| AA0602 |
|
|
O=C[C@]1(O)CCC[NH2+]1 |
C2 |
H2 |
C2 |
|
N8 |
H8, H8 |
| AA0176 |
|
|
O=C[C@H](Cc1ccc(cc1)Br)[NH3+] |
C2 |
H2 |
C2 |
|
N13 |
H13, H13 |
| AA0479 |
|
|
O=C[C@H]1[NH2+]C[C@H]([C@@H]1O)O |
C2 |
H2 |
C2 |
|
N5 |
H5, H5 |
| AA0487 |
|
|
O=C[C@H](C[C@@H](C(=O)[O-])O)[NH3+] |
C2 |
H2 |
C2 |
|
N12 |
H12, H12 |
| AA0104 |
|
|
O=C[C@H](CSC/C=C(/CC/C=C(/CC/C=C(/CCC=C(C)C)\C)\C)\C)[NH3+] |
C2 |
H2 |
C2 |
|
N27 |
H27, H27 |
| AA0258 |
|
|
O=C[C@H](CS[C@@H](C1=C(C)C(=O)N[C@H]1Cc1[nH]c(c(c1C)CCC(=O)[O-])Cc1[nH]c(c(c1CCC(=O)[O-])C)C=C1NC(=O)C(=C1C)CC)C)[NH3+] |
C2 |
H2 |
C2 |
|
N54 |
H54, H54 |
| O |
|
|
O=C[C@H](CCCCNC(=O)[C@@H]1[NH2+]CC[C@H]1C)[NH3+] |
C2 |
H2 |
C2 |
|
N22 |
H22, H22 |
| AA0497 |
|
|
[O-]P(=O)(OCC[NH3+])OC[C@H]([NH3+])C=O |
C19 |
H19 |
C19 |
|
N15 |
H15, H15 |
| C, E |
|
|
O=C[C@H](CCC(=O)OCc1cccc2c1c(C)c([nH]2)C(=O)SC[C@@H](C=O)N)[NH3+] |
C2 |
H2 |
C2 |
|
N31 |
H31, H31 |
| AA0409 |
|
|
CC[C@H]([NH3+])C=O |
C9 |
H9 |
C9 |
|
N5 |
H5, H5 |
| AA0180 |
|
|
O=C[C@H](Cc1c[nH]c2c1ccc(c2)Cl)[NH3+] |
C2 |
H2 |
C2 |
|
N17 |
H17, H17 |
| AA0448 |
|
|
O=C[C@H]([C@H]([C@@H](O)C)C)[NH3+] |
C2 |
H2 |
C2 |
|
N12 |
H12, H12 |
| AA0174 |
|
|
O=C[C@H](Cc1ccccc1Br)[NH3+] |
C2 |
H2 |
C2 |
|
N13 |
H13, H13 |
| AA0147 |
|
|
[O-]C1=CC(=O)C(=CC1=O)C[C@H]([NH3+])C=O |
C17 |
H17 |
C17 |
|
N13 |
H13, H13 |
| AA0327 |
|
|
O=C[C@H](CCCNC(=[NH2+])N[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)O)O)[NH3+] |
C2 |
H2 |
C2 |
|
N30 |
H30, H30 |
| AA0201 |
|
|
O=C[C@H](CCC(=O)NCC(=O)[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N14 |
H14, H14 |
| AA0349 |
|
|
O=C[C@H]([C@H](O[P@](=O)(OC[C@H]([C@H]([C@H](Cn1c2=C[C@@H](C)C(=Cc2nc2c1[nH]c(=O)[nH]c2=O)C)O)O)O)[O-])C)[NH3+] |
C2 |
H2 |
C2 |
|
N45 |
H45, H45 |
| AA0157 |
|
|
O=C[C@H](Cc1ccc(cc1)O[C@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)O)O)[NH3+] |
C2 |
H2 |
C2 |
|
N29 |
H29, H29 |
| AA0212 |
|
|
OC[C@@H]1O[C@H]([C@@H]([C@H]1O)O)O[C@H]1C[NH2+][C@@H](C1)C=O |
C24 |
H24 |
C24 |
|
N18 |
H18, H18 |
| AA0306 |
|
|
O=C[C@H](CSSCCNC(=O)CCNC(=O)[C@@H](C(CO[P@](=O)(O[P@](=O)(OC[C@H]1O[C@H]([C@@H]([C@@H]1OP(=O)([O-])[O-])O)n1cnc2c1ncnc2N)[O-])[O-])(C)C)O)[NH3+] |
C2 |
H2 |
C2 |
|
N60 |
H60, H60 |
| AA0079 |
|
|
CCCCCCCCCCCCCCCC(=O)O[C@@H]([C@@H](C=O)[NH3+])C |
C23 |
H23 |
C23 |
|
N25 |
H25, H25 |
| AA0155 |
|
|
O=C[C@H]([C@H](O[C@@H]1O[C@H](CO)[C@@H]([C@@H]([C@H]1NC(=O)C)O)O)C)[NH3+] |
C2 |
H2 |
C2 |
|
N28 |
H28, H28 |
| AA0347 |
|
|
CCCCCCCCCCCCCCC/C=C/[C@H]([C@@H](NC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCCOC(=O)CC[C@@H](C=O)[NH3+])CO)O |
C61 |
H61 |
C61 |
|
N63 |
H63, H63 |
| AA0228 |
|
|
O=C[C@H](CCCCN[P@](=O)(OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(N)[nH]c2=O)[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N38 |
H38, H38 |
| AA0613 |
|
|
O=C[C@H](CCC(=O)N[C@H](C(=O)[O-])CCC[NH3+])[NH3+] |
C2 |
H2 |
C2 |
|
N22 |
H22, H22 |
| AA0464 |
|
|
CO[C@@H]([C@@H](C=O)[NH3+])C |
C7 |
H7 |
C7 |
|
N9 |
H9, H9 |
| AA0227 |
|
|
O=C[C@H](CCCCN[P@](=O)(OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N)[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N36 |
H36, H36 |
| AA0114 |
|
|
O=C[C@H](CCCCNC(=O)[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N13 |
H13, H13 |
| AA0615 |
|
|
O=C[C@H](CCCCNC(=O)[C@@H](COP(=O)([O-])[O-])O)[NH3+] |
C2 |
H2 |
C2 |
|
N21 |
H21, H21 |
| E, S |
|
|
O=C[C@H](CCC(=O)OC[C@@H](C=O)N)[NH3+] |
C2 |
H2 |
C2 |
|
N16 |
H16, H16 |
| AA0078 |
|
|
CCCCCCCCCCCCCC(=O)NCCCC[C@@H](C=O)[NH3+] |
C23 |
H23 |
C23 |
|
N25 |
H25, H25 |
| AA0371 |
|
|
O=C[C@@H](Cc1ncn(c1)[P@@](=O)(OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1NC=N[C@H]2N)[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N38 |
H38, H38 |
| AA0312 |
|
|
O=C[C@H](CCCC[NH2+]C=C[C@H](C=CC=C(C=CC1=C(C)C=CCC1(C)C)C)C)[NH3+] |
C2 |
H2 |
C2 |
|
N33 |
H33, H33 |
| AA0030 |
|
|
O[C@@H]1C[C@H]([NH2+]C1)C=O |
C11 |
H11 |
C11 |
|
N7 |
H7, H7 |
| AA0406 |
|
|
O[C@H]1[C@@H](OC[C@H]([NH3+])C=O)OC[C@H]([C@@H]1O)O |
C14 |
H14 |
C14 |
|
N10 |
H10, H10 |
| AA0234 |
|
|
CSC[C@H]([NH3+])C=O |
C10 |
H10 |
C10 |
|
N6 |
H6, H6 |
| AA0558 |
|
|
[NH3+]CCCC[NH2+]CCCNC(=O)CNC(=O)[C@@H](NC(=O)CC[C@@H](C(=O)[O-])[NH3+])CSSC[C@@H](C=O)[NH3+] |
C44 |
H44 |
C44 |
|
N46 |
H46, H46 |
| AA0256 |
|
|
O=C[C@H](Cc1ccc(cc1)O[P@@](=O)(OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1ccc(=O)[nH]c1=O)[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N38 |
H38, H38 |
| C, N |
|
|
O=C[C@H](CS[C@@](CC(=O)N)(C=O)N)[NH3+] |
C2 |
H2 |
C2 |
|
N15 |
H15, H15 |
| AA0273 |
|
|
O=C[C@](CCC(=O)N)([NH3+])C |
C2 |
H2 |
C2 |
|
N9 |
H9, H9 |
| AA0272 |
|
|
C[C@H](NC(=[NH2+])N)CC[C@H]([NH3+])C=O |
C18 |
H18 |
C18 |
|
N14 |
H14, H14 |
| C, C |
|
|
NC=CSC[C@@H](C=O)[NH3+] |
C8 |
H8 |
C8 |
|
N10 |
H10, H10 |
| AA0069 |
|
|
O=C[C@H](CCC[NH2+][C]([NH2+]C)[NH3+])[NH3+] |
C2 |
H2 |
C2 |
|
N20 |
H20, H20 |
| AA0537 |
|
|
O=C[C@H](Cc1ccc(c(c1)N(=O)=O)[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N16 |
H16, H16 |
| AA0522 |
|
|
O=C[C@H](CC(=O)OC[C@@H]1C=c2c(C=C1C)nc1c(n2C[C@@H]([C@@H]([C@@H](CO[P@@](=O)(O[P@](=O)(OC[C@H]2O[C@H]([C@@H]([C@@H]2O)O)n2cnc3c2NC=N[C@H]3N)[O-])[O-])O)O)O)[nH]c(=O)[nH]c1=O)[NH3+] |
C2 |
H2 |
C2 |
|
N73 |
H73, H73 |
| AA0463 |
|
|
O=C[C@H](C(O)(C)C)[NH3+] |
C2 |
H2 |
C2 |
|
N9 |
H9, H9 |
| AA0387 |
|
|
CCCCCCCCCC(=O)O[C@@H]([C@@H](C=O)[NH3+])C |
C17 |
H17 |
C17 |
|
N19 |
H19, H19 |
| AA0146 |
|
|
O=C[C@H](Cc1ccc(c(c1)O)O)[NH3+] |
C2 |
H2 |
C2 |
|
N14 |
H14, H14 |
| AA0503 |
|
|
O=C[C@H](CCC(=O)N[C@H](C(=O)[O-])CCCC(=O)OP(=O)([O-])[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N25 |
H25, H25 |
| AA0518 |
|
|
O=C[C@H](CCC(=O)N[C@H]1O[C@H]([C@H]([C@H]1O)O)CO[P@@](=O)(O[P@](=O)(OC[C@@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1NC=N[C@H]2N)[O-])[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N54 |
H54, H54 |
| AA0389 |
|
|
OC[C@H]1O[C@@H](O[C@H]2C[NH2+][C@@H](C2)C=O)[C@@H]([C@H]([C@H]1O)O)O |
C18 |
H18 |
C18 |
|
N12 |
H12, H12 |
| AA0154 |
|
|
O=C[C@H](CO[C@@H]1O[C@H](CO)[C@@H]([C@@H]([C@H]1NC(=O)C)O)O)[NH3+] |
C2 |
H2 |
C2 |
|
N26 |
H26, H26 |
| AA0370 |
|
|
O=C[C@H](C[C@H]([C@@H](C[NH3+])O)O)[NH3+] |
C2 |
H2 |
C2 |
|
N17 |
H17, H17 |
| AA0264 |
|
|
OC[C@@H](COP(=O)(OC[C@@H](C=O)[NH3+])[O-])O |
C13 |
H13 |
C13 |
|
N15 |
H15, H15 |
| AA0039 |
|
|
O=C[C@H](Cc1ccc(cc1)OP(=O)([O-])[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N17 |
H17, H17 |
| AA0152 |
|
|
O=C[C@H](CS[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)O)O)[NH3+] |
C2 |
H2 |
C2 |
|
N23 |
H23, H23 |
| D, T |
|
|
O=C[C@H]([C@H](OC(=O)C[C@@H](C(=O)[O-])[NH3+])C)[NH3+] |
C2 |
H2 |
C2 |
|
N21 |
H21, H21 |
| AA0563 |
|
|
O=C[C@H](CSSC[C@@H](C(=O)N[C@@H]1[C@@H](O[C@@H]([C@H]([C@H]1O)O)CO)O[C@H](C(=O)[O-])CC(=O)[O-])[NH3+])[NH3+] |
C2 |
H2 |
C2 |
|
N43 |
H43, H43 |
| AA0524 |
|
|
ClNCCCC[C@@H](C=O)[NH3+] |
C9 |
H9 |
C9 |
|
N11 |
H11, H11 |
| AA0205 |
|
|
OSC[C@H]([NH3+])C=O |
C10 |
H10 |
C10 |
|
N6 |
H6, H6 |
| AA0446 |
|
|
C[C@@](CO)(C[C@H]([NH3+])C=O)O |
C12 |
H12 |
C12 |
|
N8 |
H8, H8 |
| AA0589 |
|
|
O=C[C@H](CC[C@@H](O[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)O)O)C[NH3+])[NH3+] |
C2 |
H2 |
C2 |
|
N31 |
H31, H31 |
| AA0033 |
|
|
O=C[C@H](CC(=O)OP(=O)([O-])[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N13 |
H13, H13 |
| AA0403 |
|
|
O=C[C@H]([C@H](O[C@H]1O[C@H](CO)[C@H]([C@@H]([C@@H]1O)O)O)C)[NH3+] |
C2 |
H2 |
C2 |
|
N25 |
H25, H25 |
| AA0398 |
|
|
O=C[C@H](CO[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1NC(=O)C)O)O)[NH3+] |
C2 |
H2 |
C2 |
|
N26 |
H26, H26 |
| AA0549 |
|
|
Clc1cc2c(C[C@H]([NH3+])C=O)c[nH]c2cc1 |
C13 |
H13 |
C13 |
|
N9 |
H9, H9 |
| AA0612 |
|
|
O=C[C@H](CCC(=O)N[C@H](C(=O)[O-])CCC(=O)[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N20 |
H20, H20 |
| AA0235 |
|
|
O[C@H](CC[NH3+])C[C@H]([NH3+])C=O |
C17 |
H17 |
C17 |
|
N13 |
H13, H13 |
| AA0038 |
|
|
O=C[C@H]([C@H](OP(=O)([O-])[O-])C)[NH3+] |
C2 |
H2 |
C2 |
|
N13 |
H13, H13 |
| AA0542 |
|
|
O=C[C@H](CC1C(=O)Nc2c1cccc2)[NH3+] |
C2 |
H2 |
C2 |
|
N16 |
H16, H16 |
| AA0237 |
|
|
O=C[C@H](CO[C@H]1O[C@@H]([C@H]([C@H]1O)O)CO[P@](=O)(O[P@@](=O)(OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N)[O-])[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N50 |
H50, H50 |
| AA0064 |
|
|
CSCC[C@H]([NH2+]C)C=O |
C11 |
H11 |
C11 |
|
N7 |
H7, H7 |
| AA0385 |
|
|
CCCCCCCCCC(=O)OC[C@@H](C=O)[NH3+] |
C16 |
H16 |
C16 |
|
N18 |
H18, H18 |
| AA0390 |
|
|
OC[C@H]1O[C@H](O[C@H]2C[NH2+][C@@H](C2)C=O)[C@@H]([C@H]([C@@H]1O)O)NC(=O)C |
C18 |
H18 |
C18 |
|
N12 |
H12, H12 |
| AA0402 |
|
|
O=C[C@H](CO[C@H]1O[C@H](CO)[C@H]([C@@H]([C@@H]1O)O)O)[NH3+] |
C2 |
H2 |
C2 |
|
N23 |
H23, H23 |
| AA0145 |
|
|
O=C[C@H](Cc1ccc(cc1)OCC1CC2C(CC1C)NC1C(N2C[C@@H]([C@@H]([C@@H](CO[P@@](=O)(O[P@@](=O)(OC[C@H]2O[C@H]([C@@H]([C@@H]2O)O)n2cnc3c2ncnc3N)[O-])[O-])O)O)O)NC(=O)[N-]C1=O)[NH3+] |
C2 |
H2 |
C2 |
|
N73 |
H73, H73 |
| AA0476 |
|
|
O=C[C@H](CCCC[NH2+][C@H]1O[C@@H]([C@H]([C@H]1O)O)CO[P@](=O)(O[P@@](=O)(OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1NC=N[C@H]2N)[O-])[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N56 |
H56, H56 |
| C, Q |
|
|
O=C[C@H](CCC(=O)SC[C@@H](C=O)N)[NH3+] |
C2 |
H2 |
C2 |
|
N16 |
H16, H16 |
| AA0153 |
|
|
O=C[C@H](CC[C@@H](O[C@@H]1O[C@H](CO)[C@@H]([C@@H]([C@H]1O[C@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)O)O)O)O)C[NH3+])[NH3+] |
C2 |
H2 |
C2 |
|
N47 |
H47, H47 |
| AA0531 |
|
|
O=C[C@H](CC[C@H](CNC(=O)C[C@H](CCC[NH3+])[NH3+])O)[NH3+] |
C2 |
H2 |
C2 |
|
N28 |
H28, H28 |
| AA0116 |
|
|
O=C[C@H](CCCC[NH2+]C[C@@H](CC[NH3+])O)[NH3+] |
C2 |
H2 |
C2 |
|
N22 |
H22, H22 |
| AA0568 |
|
|
O=C[C@H](CCCCNC(=O)CC(=O)[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N16 |
H16, H16 |
| AA0223 |
|
|
O=C[C@H](CSC[C@@H](OCC[C@@H](CCC[C@@H](CCC[C@@H](CCCC(C)C)C)C)C)COCC[C@@H](CCC[C@@H](CCC[C@@H](CCCC(C)C)C)C)C)[NH3+] |
C2 |
H2 |
C2 |
|
N59 |
H59, H59 |
| AA0509 |
|
|
O=C[C@H](Cc1ccc(c(c1)I)O)[NH3+] |
C2 |
H2 |
C2 |
|
N14 |
H14, H14 |
| AA0445 |
|
|
C[C@](CO)(C[C@H]([NH3+])C=O)O |
C12 |
H12 |
C12 |
|
N8 |
H8, H8 |
| E, G |
|
|
O=CCNC(=O)CC[C@@H](C=O)[NH3+] |
C11 |
H11 |
C11 |
|
N13 |
H13, H13 |
| AA0229 |
|
|
O=C[C@H](CSSC[C@@H](C(=O)NCC(=O)[O-])NC(=O)CC[C@@H](C(=O)[O-])[NH3+])[NH3+] |
C2 |
H2 |
C2 |
|
N32 |
H32, H32 |
| AA0426 |
|
|
CCCCCC=CC=C1C(=O)C[C@H]([C@@H]1CC=CCCCC(=O)[O-])SC[C@@H](C=O)[NH3+] |
C30 |
H30 |
C30 |
|
N32 |
H32, H32 |
| AA0458 |
|
|
O=C[C@H](C(=O)[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N8 |
H8, H8 |
| AA0590 |
|
|
CCCCCCCC/C=C\CCCCCCCC(=O)NCCCC[C@@H](C=O)[NH3+] |
C27 |
H27 |
C27 |
|
N29 |
H29, H29 |
| AA0305 |
|
|
O=C[C@H](CCCN([C]([NH3+])N)C)[NH3+] |
C2 |
H2 |
C2 |
|
N16 |
H16, H16 |
| K, T |
|
|
O=C[C@H](CCCCNC(=O)[C@H]([C@H](O)C)[NH3+])[NH3+] |
C2 |
H2 |
C2 |
|
N22 |
H22, H22 |
| AA0325 |
|
|
O=C[C@H](Cc1ncn(c1)[P@@](=O)(OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1nc(N)[nH]c2=O)[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N39 |
H39, H39 |
| AA0115 |
|
|
O=C[C@H](CCCC[NH2+][C@H](C(=O)[O-])C)[NH3+] |
C2 |
H2 |
C2 |
|
N18 |
H18, H18 |
| AA0080 |
|
|
CCCCCCCCCCCCCCCC(=O)OC[C@@H](C=O)[NH3+] |
C22 |
H22 |
C22 |
|
N24 |
H24, H24 |
| AA0607 |
|
|
O=C[C@H](CO[C@@H]1O[C@H](C)[C@H]([C@@H]([C@H]1NC(=O)C)O)NC(=O)C)[NH3+] |
C2 |
H2 |
C2 |
|
N28 |
H28, H28 |
| AA0217 |
|
|
O=C[C@H](Cc1c([nH]c2c1cccc2)[C@H]1O[C@H](CO)[C@H]([C@@H]([C@@H]1O)O)O)[NH3+] |
C2 |
H2 |
C2 |
|
N32 |
H32, H32 |
| G, K |
|
|
O=C[C@H](CCCCNC(=O)C[NH3+])[NH3+] |
C2 |
H2 |
C2 |
|
N17 |
H17, H17 |
| AA0198 |
|
|
O=C[C@@H](Cc1c[nH]c2c1cccc2)[NH3+] |
C2 |
H2 |
C2 |
|
N16 |
H16, H16 |
| AA0455 |
|
|
CCCCCC/C=C\CCCCCCCC(=O)OC[C@@H](C=O)[NH3+] |
C22 |
H22 |
C22 |
|
N24 |
H24, H24 |
| AA0338 |
|
|
O=C[C@H](Cc1ccc(cc1)O)[NH2+]C |
C2 |
H2 |
C2 |
|
N13 |
H13, H13 |
| AA0523 |
|
|
O=C[C@H](CCCNC(=[NH+]C)N(C)C)[NH3+] |
C2 |
H2 |
C2 |
|
N16 |
H16, H16 |
| AA0337 |
|
|
C[NH2+][C@@H](CC(C)C)C=O |
C11 |
H11 |
C11 |
|
N2 |
H2, H2 |
| AA0505 |
|
|
O=C[C@H](CCC(=O)N[C@H](C(=O)[O-])CCCC[NH3+])[NH3+] |
C2 |
H2 |
C2 |
|
N23 |
H23, H23 |
| AA0191 |
|
|
C[C@@H]([NH3+])C=O |
C8 |
H8 |
C8 |
|
N4 |
H4, H4 |
| AA0118 |
|
|
O=C[C@H](CCCCNC(=O)CCCC[C@@H]1CCSS1)[NH3+] |
C2 |
H2 |
C2 |
|
N22 |
H22, H22 |
| H, Y |
|
|
O=C[C@H]([C@H](n1cncc1C[C@@H](C=O)[NH3+])c1ccc(cc1)O)N |
C15 |
H15 |
C15 |
|
N17 |
H17, H17 |
| AA0521 |
|
|
O=C[C@H](C(C)C)[NH2+]CC[C@@H]([C@@H](COP(O)O)O)O |
C2 |
H2 |
C2 |
|
N8 |
H8, H8 |
| AA0269 |
|
|
SSC[C@H]([NH3+])C=O |
C10 |
H10 |
C10 |
|
N6 |
H6, H6 |
| AA0608 |
|
|
OC[C@@H](C(=O)N[C@@H]1[C@@H](C)O[C@H]([C@@H]([C@H]1O)NC(=O)C)OC[C@@H](C=O)[NH3+])O |
C29 |
H29 |
C29 |
|
N31 |
H31, H31 |
| AA0527 |
|
|
CCCCCCCC(=O)NCCCC[C@@H](C=O)[NH3+] |
C17 |
H17 |
C17 |
|
N19 |
H19, H19 |
| H, M |
|
|
CSCC[C@H](NCn1cnc(c1)C[C@@H](C=O)[NH3+])C=O |
C17 |
H17 |
C17 |
|
N19 |
H19, H19 |
| AA0399 |
|
|
O=C[C@H]([C@H](O[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1NC(=O)C)O)O)C)[NH3+] |
C2 |
H2 |
C2 |
|
N28 |
H28, H28 |
| AA0251 |
|
|
O=C[C@H](CCS(=O)(=O)C)[NH3+] |
C2 |
H2 |
C2 |
|
N11 |
H11, H11 |
| AA0443 |
|
|
OC[C@@H](C[C@@H](C=O)[NH3+])C |
C8 |
H8 |
C8 |
|
N10 |
H10, H10 |
| AA0211 |
|
|
O=CNCCCC[C@@H](C=O)[NH3+] |
C10 |
H10 |
C10 |
|
N12 |
H12, H12 |
| AA0358 |
|
|
O=C[C@H](CS[Se]C[C@@H](C=O)N)[NH3+] |
C2 |
H2 |
C2 |
|
N14 |
H14, H14 |
| AA0221 |
|
|
O=C[C@H](Cc1ncn(c1)C[C@@H]1C=c2c(C=C1C)[nH+]c1c(n2C[C@@H]([C@@H]([C@@H](CO[P@@](=O)(O[P@@](=O)(OC[C@H]2O[C@H]([C@@H]([C@@H]2O)O)n2cnc3c2NC=N[C@H]3N)[O-])[O-])O)O)O)[nH]c(=O)[nH]c1=O)[NH3+] |
C2 |
H2 |
C2 |
|
N76 |
H76, H76 |
| AA0028 |
|
|
[NH3+]C[C@@H](CC[C@@H](C=O)[NH3+])O |
C12 |
H12 |
C12 |
|
N14 |
H14, H14 |
| AA0282 |
|
|
O=C[C@H]1[NH2+]C[C@@H]([C@@H]1O)O |
C2 |
H2 |
C2 |
|
N5 |
H5, H5 |
| AA0520 |
|
|
Oc1cccc2c1[nH]cc2C[C@H]([NH3+])C=O |
C19 |
H19 |
C19 |
|
N15 |
H15, H15 |
| AA0392 |
|
|
O=C[C@H](CS[C@@H]1O[C@H](CO)[C@@H]([C@@H]([C@H]1O)O)O)[NH3+] |
C2 |
H2 |
C2 |
|
N23 |
H23, H23 |
| AA0203 |
|
|
O=C[C@H](Cc1ccc(cc1)O[P@](=O)(OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N)[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N39 |
H39, H39 |
| AA0506 |
|
|
O=C[C@H](Cc1c([nH]c2c1cccc2O)[C@H]1O[C@H](CO)[C@H]([C@@H]([C@@H]1O)O)O)[NH3+] |
C2 |
H2 |
C2 |
|
N33 |
H33, H33 |
| AA0373 |
|
|
O=CC[C@@H](C=O)[NH3+] |
C6 |
H6 |
C6 |
|
N8 |
H8, H8 |
| AA0199 |
|
|
C[C@H]([C@@H]([NH3+])C=O)O |
C10 |
H10 |
C10 |
|
N6 |
H6, H6 |
| AA0561 |
|
|
O=C[C@H](CS[C@@H](C(=O)[O-])CC(=O)[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N16 |
H16, H16 |
| C, M |
|
|
CSCC[C@@](SC[C@@H](C=O)[NH3+])(C=O)N |
C10 |
H10 |
C10 |
|
N12 |
H12, H12 |
| AA0400 |
|
|
O=C[C@H](CO[C@H]1O[C@H](CO)[C@@H]([C@@H]([C@H]1O)O)O)[NH3+] |
C2 |
H2 |
C2 |
|
N23 |
H23, H23 |
| C, G |
|
|
C([C@H]([NH3+])C=O)SSC(=O)C[NH3+] |
C8 |
H8 |
C8 |
|
N4 |
H4, H4 |
| AA0317 |
|
|
Cn1cc(nc1)C[C@H]([NH3+])C=O |
C14 |
H14 |
C14 |
|
N10 |
H10, H10 |
| AA0449 |
|
|
OC[C@@H]([C@@H]([C@@H](C=O)[NH3+])C)O |
C9 |
H9 |
C9 |
|
N11 |
H11, H11 |
| AA0579 |
|
|
O=C[C@H]([C@@H](C(=O)[O-])O)[NH3+] |
C2 |
H2 |
C2 |
|
N11 |
H11, H11 |
| AA0431 |
|
|
OCC(n1cnc(c1)C[C@@H](C=O)[NH3+])(CO)O |
C12 |
H12 |
C12 |
|
N14 |
H14, H14 |
| C, W |
|
|
O=C[C@H](Cc1c([nH]c2c1ccc(c2)O)[S@](=O)C[C@@H](C=O)N)[NH3+] |
C2 |
H2 |
C2 |
|
N25 |
H25, H25 |
| AA0362 |
|
|
O=C[C@H]([C@H](OS(=O)(=O)[O-])C)[NH3+] |
C2 |
H2 |
C2 |
|
N13 |
H13, H13 |
| AA0214 |
|
|
O=C[C@H](CCCNC(=O)N)[NH3+] |
C2 |
H2 |
C2 |
|
N12 |
H12, H12 |
| AA0536 |
|
|
O=C[C@H]([C@H](OC(=O)CC[C@@H](C(=O)[O-])[NH3+])C)[NH3+] |
C2 |
H2 |
C2 |
|
N22 |
H22, H22 |
| AA0386 |
|
|
C[C@H]([C@H]([NH3+])C=O)OC(=O)CCCCCCC |
C10 |
H10 |
C10 |
|
N6 |
H6, H6 |
| AA0296 |
|
|
O=C[C@H](COP(=O)(O[C@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1NC(=O)C)O)O)[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N30 |
H30, H30 |
| AA0581 |
|
|
O=C[C@H](CC[S@](=O)C)[NH3+] |
C2 |
H2 |
C2 |
|
N10 |
H10, H10 |
| K, N |
|
|
O=C[C@H](CCCCNC(=O)C[C@@H](C=O)N)[NH3+] |
C2 |
H2 |
C2 |
|
N18 |
H18, H18 |
| AA0252 |
|
|
O=C[C@H](CSCc1[nH]c(c(c1CC(=O)[O-])CCC(=O)[O-])Cc1[nH]cc(c1CC(=O)[O-])CCC(=O)[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N39 |
H39, H39 |
| AA0427 |
|
|
O=C[C@H](CS[C@@H](C1=C(C)C(=O)N[C@H]1Cc1[nH]c(c(c1C)CCC(=O)[O-])Cc1[nH]c(c(c1CCC(=O)[O-])C)C[C@H]1NC(=O)C(=C1C)C=C)C)[NH3+] |
C2 |
H2 |
C2 |
|
N55 |
H55, H55 |
| AA0169 |
|
|
O=C[C@H](CS[C@@H]1O[C@@H]([C@H]([C@H]1O)O)CO[P@](=O)(O[P@@](=O)(OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N)[O-])[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N50 |
H50, H50 |
| D, K |
|
|
O=C[C@H](CCCCNC(=O)[C@H](CC(=O)[O-])[NH3+])[NH3+] |
C2 |
H2 |
C2 |
|
N22 |
H22, H22 |
| AA0423 |
|
|
O=C[C@H]([C@H](OC(=O)C)C)[NH3+] |
C2 |
H2 |
C2 |
|
N12 |
H12, H12 |
| AA0401 |
|
|
O=C[C@H]([C@H](O[C@H]1O[C@H](CO)[C@@H]([C@@H]([C@H]1O)O)O)C)[NH3+] |
C2 |
H2 |
C2 |
|
N25 |
H25, H25 |
| G, S |
|
|
NCC(=O)OC[C@H]([NH3+])C=O |
C13 |
H13 |
C13 |
|
N9 |
H9, H9 |
| C, F |
|
|
O=C[C@](Cc1ccccc1)(SC[C@@H](C=O)[NH3+])N |
C15 |
H15 |
C15 |
|
N17 |
H17, H17 |
| AA0442 |
|
|
O=C[C@H](CC(O)(C)C)[NH3+] |
C2 |
H2 |
C2 |
|
N10 |
H10, H10 |
| AA0546 |
|
|
CC[C@H]([C@@H](C=O)[NH3+])C |
C7 |
H7 |
C7 |
|
N9 |
H9, H9 |
| AA0103 |
|
|
O=C[C@H](CSC/C=C(/CC/C=C(/CC/C=C(\CO)/C)\C)\C)[NH3+] |
C2 |
H2 |
C2 |
|
N23 |
H23, H23 |
| AA0432 |
|
|
O=C[C@H](CC(=O)OSC(=O)[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N13 |
H13, H13 |
| AA0444 |
|
|
O=C[C@@H](C[C@@H](C=O)[NH3+])C |
C8 |
H8 |
C8 |
|
N10 |
H10, H10 |
| AA0614 |
|
|
O=C[C@H](CCC(=O)SCCNC(=O)CCNC(=O)[C@@H](C(CO[P@](=O)(O[P@](=O)(OC[C@H]1O[C@H]([C@@H]([C@@H]1OP(=O)([O-])[O-])O)n1cnc2c1ncnc2N)[O-])[O-])(C)C)O)[NH3+] |
C2 |
H2 |
C2 |
|
N62 |
H62, H62 |
| K, S |
|
|
O=C[C@H](CCCC[NH2+]C[C@@H](C=O)N)[NH3+] |
C2 |
H2 |
C2 |
|
N18 |
H18, H18 |
| AA0200 |
|
|
O=C[C@@H](C(C)C)[NH3+] |
C2 |
H2 |
C2 |
|
N8 |
H8, H8 |
| AA0435 |
|
|
COC(=O)C[C@H]([NH3+])C=O |
C12 |
H12 |
C12 |
|
N8 |
H8, H8 |
| AA0102 |
|
|
O=C[C@H](CSC/C=C(/CC/C=C(/CCC=C(C)C)\C)\C)[NH3+] |
C2 |
H2 |
C2 |
|
N22 |
H22, H22 |
| AA0032 |
|
|
O=C[C@H](CC(C(=O)[O-])C(=O)[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N13 |
H13, H13 |
| AA0175 |
|
|
O=C[C@H](Cc1cccc(c1)Br)[NH3+] |
C2 |
H2 |
C2 |
|
N13 |
H13, H13 |
| AA0263 |
|
|
O=C[C@H](Cc1cc(O)c(c(c1)O)O)[NH3+] |
C2 |
H2 |
C2 |
|
N15 |
H15, H15 |
| AA0609 |
|
|
O=C[C@H](CCCNC(=[NH2+])N[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1NC(=O)C)O)O)[NH3+] |
C2 |
H2 |
C2 |
|
N33 |
H33, H33 |
| AA0428 |
|
|
O=C[C@H](CS[C@H](C1=C(C)C(=O)NC1=Cc1[nH]c(c(c1C)CCC(=O)[O-])Cc1[nH]c(c(c1CCC(=O)[O-])C)C[C@H]1NC(=O)C(=C1C)C=C)C)[NH3+] |
C2 |
H2 |
C2 |
|
N54 |
H54, H54 |
| AA0545 |
|
|
O=C[C@H](CCCCNC(=O)CCC(=O)[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N17 |
H17, H17 |
| AA0578 |
|
|
[NH3+]C[C@H](CC[C@@H](C=O)[NH3+])O |
C12 |
H12 |
C12 |
|
N14 |
H14, H14 |
| AA0167 |
|
|
SCCNC(=O)CCNC(=O)[C@@H](C(CO[P@](=O)(O[P@](=O)(OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O[C@H]1O[C@@H]([C@H]([C@H]1O)O)CO[P@@](=O)(OC[C@@H](C=O)[NH3+])[O-])n1cnc2c1ncnc2N)[O-])[O-])(C)C)O |
C54 |
H54 |
C54 |
|
N56 |
H56, H56 |
| AA0197 |
|
|
O=C[C@@H](CC(C)C)[NH3+] |
C2 |
H2 |
C2 |
|
N9 |
H9, H9 |
| AA0514 |
|
|
O=C[C@H]([C@H](O[C@H]1O[C@H](COP(=O)([O-])[O-])[C@H]([C@H]([C@@H]1O)O)O)C)[NH3+] |
C2 |
H2 |
C2 |
|
N29 |
H29, H29 |
| AA0194 |
|
|
O=C[C@@H](Cc1ccccc1)[NH3+] |
C2 |
H2 |
C2 |
|
N12 |
H12, H12 |
| AA0533 |
|
|
C[NH2+][C@H](C=O)CO |
C7 |
H7 |
C7 |
|
N2 |
H2, H2 |
| AA0068 |
|
|
O=C[C@H](CCC[NH2+][C](N(C)C)[NH3+])[NH3+] |
C2 |
H2 |
C2 |
|
N19 |
H19, H19 |
| AA0202 |
|
|
O=C[C@H](CCC(=O)N[C@H](C(=O)[O-])CCC(=O)[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N20 |
H20, H20 |
| AA0350 |
|
|
O=C[C@H](CO[P@](=O)(OC[C@H]([C@H]([C@H](Cn1c2=C[C@@H](C)C(=Cc2nc2c1[nH]c(=O)[nH]c2=O)C)O)O)O)[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N43 |
H43, H43 |
| AA0297 |
|
|
O=C[C@H](COP(=O)(O[C@H]1O[C@H](CO)[C@H]([C@@H]([C@@H]1O)O)O)[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N27 |
H27, H27 |
| AA0215 |
|
|
O=C[C@H](C[C@H](CNC(=[NH2+])N)O)[NH3+] |
C2 |
H2 |
C2 |
|
N16 |
H16, H16 |
| AA0287 |
|
|
O=C[C@H](CCCC[NH2+][C@@H](C(=O)[O-])C)[NH3+] |
C2 |
H2 |
C2 |
|
N18 |
H18, H18 |
| AA0220 |
|
|
O=C[C@H](CSc1c(C)c(C)cc2c1[nH]c1c(=O)[nH]c(=O)[nH]c1n2C[C@@H]([C@@H]([C@@H](COP(=O)([O-])[O-])O)O)O)[NH3+] |
C2 |
H2 |
C2 |
|
N44 |
H44, H44 |
| AA0170 |
|
|
OC[C@H](COP(=O)(OCCNC(=O)CC[C@@H](C=O)[NH3+])[O-])O |
C19 |
H19 |
C19 |
|
N21 |
H21, H21 |
| AA0034 |
|
|
O=C[C@H](CSP(=O)([O-])[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N11 |
H11, H11 |
| AA0195 |
|
|
OC[C@@H]([NH3+])C=O |
C9 |
H9 |
C9 |
|
N5 |
H5, H5 |
| AA0336 |
|
|
CC[C@@H]([C@H]([NH2+]C)C=O)C |
C11 |
H11 |
C11 |
|
N7 |
H7, H7 |
| AA0361 |
|
|
O=C[C@H](COS(=O)(=O)[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N11 |
H11, H11 |
| C, T |
|
|
O=C[C@H](CS[C@@]([C@H](O)C)(C=O)N)[NH3+] |
C2 |
H2 |
C2 |
|
N15 |
H15, H15 |
| AA0122 |
|
|
O=C[C@H](CCCC(=O)[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N11 |
H11, H11 |
| AA0035 |
|
|
O=C[C@@H](Cc1ncn(c1)P(=O)([O-])[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N15 |
H15, H15 |
| AA0510 |
|
|
O=C[C@H](Cc1cc(I)c(c(c1)I)[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N15 |
H15, H15 |
| AA0055 |
|
|
O=C[C@H](CCCCNC(=O)C)[NH3+] |
C2 |
H2 |
C2 |
|
N13 |
H13, H13 |
| AA0499 |
|
|
O=C[C@H](CO[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1NC(=O)C)O)NC(=O)C)[NH3+] |
C2 |
H2 |
C2 |
|
N29 |
H29, H29 |
| AA0532 |
|
|
CCCC(=O)NCCCC[C@@H](C=O)[NH3+] |
C13 |
H13 |
C13 |
|
N15 |
H15, H15 |
| AA0543 |
|
|
O=C[C@H](C[C@@H]1C(=O)Nc2c1cccc2)[NH3+] |
C2 |
H2 |
C2 |
|
N17 |
H17, H17 |
| AA0475 |
|
|
O=C[C@H](CCCCNC(=O)CC)[NH3+] |
C2 |
H2 |
C2 |
|
N14 |
H14, H14 |
| AA0352 |
|
|
O=C[C@H](Cc1ncn(c1)C[C@@H]1C=c2c(C=C1C)nc1c(n2C[C@@H]([C@@H]([C@@H](COP(=O)([O-])[O-])O)O)O)[nH]c(=O)[nH]c1=O)[NH3+] |
C2 |
H2 |
C2 |
|
N48 |
H48, H48 |
| AA0625 |
|
|
O=C[C@H](CS[C@]([C@H](O)C)(C=O)N)[NH3+] |
C2 |
H2 |
C2 |
|
N15 |
H15, H15 |
| AA0405 |
|
|
O=C[C@H]([C@H](O[C@H]1O[C@H](C)[C@@H]([C@@H]([C@H]1O)O)O)C)[NH3+] |
C2 |
H2 |
C2 |
|
N24 |
H24, H24 |
| A, C |
|
|
O=C[C@H](CS[C@](C=O)(N)C)[NH3+] |
C2 |
H2 |
C2 |
|
N12 |
H12, H12 |
| AA0397 |
|
|
O=C[C@H](CO[C@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)O)O)[NH3+] |
C2 |
H2 |
C2 |
|
N23 |
H23, H23 |
| AA0121 |
|
|
O=CCCC[C@@H](C=O)[NH3+] |
C8 |
H8 |
C8 |
|
N10 |
H10, H10 |
| AA0061 |
|
|
C[C@H]([NH2+]C)C=O |
C8 |
H8 |
C8 |
|
N4 |
H4, H4 |
| AA0548 |
|
|
NC=CSC[C@H](C=O)[NH3+] |
C8 |
H8 |
C8 |
|
N10 |
H10, H10 |
| AA0173 |
|
|
Brc1nc(c[nH]1)C[C@H]([NH3+])C=O |
C15 |
H15 |
C15 |
|
N11 |
H11, H11 |
| AA0148 |
|
|
O=C[C@H](Cc1c[nH]c2c1C=CC(=O)C2=O)[NH3+] |
C2 |
H2 |
C2 |
|
N18 |
H18, H18 |
| AA0391 |
|
|
O=C[C@H](CS[C@@](C(=O)[O-])(OP(=O)([O-])[O-])C)[NH3+] |
C2 |
H2 |
C2 |
|
N17 |
H17, H17 |
| AA0027 |
|
|
O=C[C@H]([C@H](C(=O)[O-])O)[NH3+] |
C2 |
H2 |
C2 |
|
N11 |
H11, H11 |
| AA0192 |
|
|
CC[C@@H]([C@H](C=O)[NH3+])C |
C7 |
H7 |
C7 |
|
N9 |
H9, H9 |
| AA0596 |
|
|
O=C[C@H](CCC(=O)NCCc1c[nH]cn1)[NH3+] |
C2 |
H2 |
C2 |
|
N18 |
H18, H18 |
| AA0422 |
|
|
O=C[C@H](CO[C@@H]1O[C@H](C)[C@@H]([C@@H]([C@H]1NC(=O)C)O)O)[NH3+] |
C2 |
H2 |
C2 |
|
N25 |
H25, H25 |
| AA0450 |
|
|
O=C[C@H](Cc1c2ccccc2[nH]c1S(=O)(=O)C)[NH3+] |
C2 |
H2 |
C2 |
|
N20 |
H20, H20 |
| AA0077 |
|
|
CCCCCCCCCCCCCCCC(=O)NCCCC[C@@H](C=O)[NH3+] |
C25 |
H25 |
C25 |
|
N27 |
H27, H27 |
| I, T |
|
|
O=C[C@H]([C@H](CC)C)N[C@@H]1C=Cc2c([C@H]1O)nc(cc2[C@@H](O)C)C(=O)O[C@@H]([C@@H](C=O)[NH3+])C |
C35 |
H35 |
C35 |
|
N37 |
H37, H37 |
| AA0618 |
|
|
O=C[C@H](COC(=O)C[C@H](OC(=O)C[C@H](O)C)C)[NH3+] |
C2 |
H2 |
C2 |
|
N21 |
H21, H21 |
| AA0036 |
|
|
O=C[C@H](Cc1cncn1P(=O)([O-])[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N15 |
H15, H15 |
| AA0502 |
|
|
O=C[C@H](CCC(=O)N[C@H](C(=O)[O-])CCCC(=O)[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N21 |
H21, H21 |
| AA0076 |
|
|
C[NH2+]CCCC[C@@H](C=O)[NH3+] |
C11 |
H11 |
C11 |
|
N13 |
H13, H13 |
| AA0304 |
|
|
O=C[C@H](C(C(=O)[O-])C(=O)[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N12 |
H12, H12 |
| AA0601 |
|
|
NC(=[NH2+])NCC[C@H]([C@H]([NH3+])C=O)O |
C17 |
H17 |
C17 |
|
N13 |
H13, H13 |
| AA0372 |
|
|
O=C[C@@H](Cc1ncn(c1)[P@@](=O)(OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1ccc(=O)[nH]c1=O)[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N36 |
H36, H36 |
| AA0528 |
|
|
Oc1cc2c(CCNC(=O)CC[C@H]([NH3+])C=O)c[nH]c2cc1 |
C19 |
H19 |
C19 |
|
N15 |
H15, H15 |
| AA0275 |
|
|
O=C[C@H](C(C)C)[NH2+][C@H](C(=O)[O-])C |
C2 |
H2 |
C2 |
|
N8 |
H8, H8 |
| AA0178 |
|
|
O=C[C@H](Cc1cc(I)c(c(c1)I)Oc1cc(I)c(c(c1)I)O)[NH3+] |
C2 |
H2 |
C2 |
|
N24 |
H24, H24 |
| AA0253 |
|
|
NC=CS[C@H]([C@@H](C=O)[NH3+])C |
C9 |
H9 |
C9 |
|
N11 |
H11, H11 |
| AA0585 |
|
|
O=C[C@H](CCCCNP(=O)([O-])[O-])[NH3+] |
C2 |
H2 |
C2 |
|
N14 |
H14, H14 |
| AA0072 |
|
|
O=C[C@H](CCC(=O)OC)[NH3+] |
C2 |
H2 |
C2 |
|
N11 |
H11, H11 |
| AA0404 |
|
|
O=C[C@H](CO[C@H]1O[C@H](C)[C@@H]([C@@H]([C@H]1O)O)O)[NH3+] |
C2 |
H2 |
C2 |
|
N22 |
H22, H22 |
| AA0232 |
|
|
CS[C@@H]([C@@H](C=O)[NH3+])C(=O)[O-] |
C7 |
H7 |
C7 |
|
N9 |
H9, H9 |
| AA0071 |
|
|
O=C[C@H](CCC(=O)NC)[NH3+] |
C2 |
H2 |
C2 |
|
N11 |
H11, H11 |
| AA0504 |
|
|
O=CCCC[C@@H](C(=O)[O-])NC(=O)CC[C@@H](C=O)[NH3+] |
C18 |
H18 |
C18 |
|
N20 |
H20, H20 |
| AA0063 |
|
|
C[NH2+]CC=O |
C6 |
H6 |
C6 |
|
N2 |
H2, H2 |
| AA0519 |
|
|
O=C[C@H]([C@H](O[C@H]1O[C@H]([C@H]([C@H]1O)O)CO[P@@](=O)(O[P@](=O)(OC[C@@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1NC=N[C@H]2N)[O-])[O-])C)[NH3+] |
C2 |
H2 |
C2 |
|
N53 |
H53, H53 |
| AA0316 |
|
|
CCC[C@@H](C(=O)CCC(=O)CC=CCCCCCC(=O)[O-])OC(=O)C[C@@H](C=O)[NH3+] |
C29 |
H29 |
C29 |
|
N31 |
H31, H31 |
| AA0156 |
|
|
O=C[C@H](Cc1cn(c2c1cccc2)[C@H]1O[C@H](CO)[C@H]([C@@H]([C@@H]1O)O)O)[NH3+] |
C2 |
H2 |
C2 |
|
N31 |
H31, H31 |
| AA0364 |
|
|
O=C[C@H](COC(=O)C)[NH3+] |
C2 |
H2 |
C2 |
|
N10 |
H10, H10 |
| AA0065 |
|
|
O=C[C@H](Cc1ccccc1)[NH2+]C |
C2 |
H2 |
C2 |
|
N12 |
H12, H12 |
| AA0144 |
|
|
O=C[C@H](Cc1cncn1CC1CC2C(CC1C)NC1C(N2C[C@@H]([C@@H]([C@@H](CO[P@](=O)(O[P@@](=O)(OC[C@H]2O[C@H]([C@@H]([C@@H]2O)O)n2cnc3c2ncnc3N)[O-])[O-])O)O)O)NC(=O)[N-]C1=O)[NH3+] |
C2 |
H2 |
C2 |
|
N71 |
H71, H71 |
| AA0277 |
|
|
[SeH]SC[C@H]([NH3+])C=O |
C11 |
H11 |
C11 |
|
N7 |
H7, H7 |
| AA0624 |
|
|
O=C[C@H](CS[C@](C=O)(CO)N)[NH3+] |
C2 |
H2 |
C2 |
|
N13 |
H13, H13 |
| AA0616 |
|
|
O=C[C@H](CC[S](C)C)[NH3+] |
C2 |
H2 |
C2 |
|
N10 |
H10, H10 |
| AA0132 |
|
|
O=C[C@H](CS[C@@H]([C@H]1C(=C[C@@H]2[NH2+]C(=Cc3[nH]c(c(c3CCC(=O)[O-])C)C[C@H]3NC(=O)C(=C3C)C=C)C(=C2C)CCC(=O)[O-])NC(=O)[C@H]1C)C)[NH3+] |
C2 |
H2 |
C2 |
|
N58 |
H58, H58 |
| AA0179 |
|
|
O=C[C@H](Cc1c[nH]c2c1ccc(c2)Br)[NH3+] |
C2 |
H2 |
C2 |
|
N17 |
H17, H17 |
| AA0222 |
|
|
O=C[C@H](CCCNC(=[NH+]P(=O)([O-])[O-])N)[NH3+] |
C2 |
H2 |
C2 |
|
N17 |
H17, H17 |
| AA0131 |
|
|
O=C[C@H](CS[C@@H]([C@H]1C(=CC2=C(C)[C@@H](C(=Cc3[nH]c(c(c3CCC(=O)[O-])C)C=C3NC(=O)C(=C3C)CC)[NH2+]2)CCC(=O)[O-])NC(=O)[C@H]1C)C)[NH3+] |
C2 |
H2 |
C2 |
|
N57 |
H57, H57 |
| AA0267 |
|
|
O=C[C@H]([C@H](O[P@](=O)(OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2N)[O-])C)[NH3+] |
C2 |
H2 |
C2 |
|
N35 |
H35, H35 |
| AA0340 |
|
|
O=C[C@@](Cc1ccccc1)(SC[C@@H](C=O)[NH3+])N |
C15 |
H15 |
C15 |
|
N17 |
H17, H17 |
| AA0107 |
|
|
CCCCCCCCCCCCCCCC(=O)OC[C@H](OC(=O)CCCCCCC/C=C\CCCCCCCC)CSC[C@@H](C=O)[NH3+] |
C47 |
H47 |
C47 |
|
N49 |
H49, H49 |
| AA0073 |
|
|
Cn1cncc1C[C@H]([NH3+])C=O |
C14 |
H14 |
C14 |
|
N10 |
H10, H10 |
| AA0029 |
|
|
O=C[C@H]1[NH2+]CC[C@@H]1O |
C2 |
H2 |
C2 |
|
N5 |
H5, H5 |
| AA0473 |
|
|
O=C[C@H]1[NH2+][C@H](C[C@@H]1C)O |
C2 |
H2 |
C2 |
|
N5 |
H5, H5 |
| AA0143 |
|
|
O=C[C@H](CSCC1CC2C(CC1C)NC1C(N2C[C@@H]([C@@H]([C@@H](CO[P@@](=O)(O[P@](=O)(OC[C@H]2O[C@H]([C@@H]([C@@H]2O)O)n2cnc3c2ncnc3N)[O-])[O-])O)O)O)NC(=O)[N-]C1=O)[NH3+] |
C2 |
H2 |
C2 |
|
N67 |
H67, H67 |
| AA0564 |
|
|
O=C[C@H](CCCC[NH2+]CCCC[NH3+])[NH3+] |
C2 |
H2 |
C2 |
|
N20 |
H20, H20 |
| AA0101 |
|
|
CSSC[C@H]([NH3+])C=O |
C11 |
H11 |
C11 |
|
N7 |
H7, H7 |
| AA0353 |
|
|
O=C[C@H](Cc1cncn1CC1CC2C(CC1C)NC1C(N2C[C@@H]([C@@H]([C@@H](COP(=O)([O-])[O-])O)O)O)NC(=O)[N-]C1=O)[NH3+] |
C2 |
H2 |
C2 |
|
N45 |
H45, H45 |
| AA0291 |
|
|
O=C[C@H](CO[C@H]1O[C@H](C(=O)[O-])[C@H]([C@@H]([C@H]1O)O)O)[NH3+] |
C2 |
H2 |
C2 |
|
N24 |
H24, H24 |